5-[(3-Chlorophenyl)amino]-1,3,4-thiadiazole-2-thiol

Base Information

Chemical Name:5-[(3-Chlorophenyl)amino]-1,3,4-thiadiazole-2-thiol
CAS No.:76462-59-4
Molecular Formula:C₈H₆ClN₃S₂
Molecular Weight:243.741
Hs Code.:
ChEMBL ID:CHEMBL1304079
DSSTox Substance ID:DTXSID301333724
Wikidata:Q27190838

Synonyms:5-[(3-chlorophenyl)amino]-1,3,4-thiadiazole-2-thiol;76462-59-4;5-(3-chloroanilino)-3H-1,3,4-thiadiazole-2-thione;1,3,4-Thiadiazole-2(3H)-thione, 5-[(3-chlorophenyl)amino]-;MLS001007562;CHEMBL1304079;CHEBI:111224;DTXSID301333724;HMS2695K10;MFCD06655525;AKOS000118283;SMR000384659;EN300-12832;AB00621340-02;SR-01000065943;SR-01000065943-1;Q27190838;Z85923153

Suppliers and Price of 5-[(3-Chlorophenyl)amino]-1,3,4-thiadiazole-2-thiol

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

Total 3 raw suppliers

Chemical Property of 5-[(3-Chlorophenyl)amino]-1,3,4-thiadiazole-2-thiol

Chemical Property:

XLogP3:2.9
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:242.9691672
Heavy Atom Count:14
Complexity:269

Purity/Quality:: 99% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:C1=CC(=CC(=C1)Cl)NC2=NNC(=S)S2

Technology Process of 5-[(3-Chlorophenyl)amino]-1,3,4-thiadiazole-2-thiol

There total 4 articles about 5-[(3-Chlorophenyl)amino]-1,3,4-thiadiazole-2-thiol which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 80.0%

: 75-15-0,12122-00-8
carbon disulfide

: 42135-76-2
4-(3-chlorophenyl)-3-thiosemicarbazide

: 76462-59-4
5-(3-Chloro-phenylamino)-[1,3,4]thiadiazole-2-thiol

Guidance literature:: With potassium hydroxide; In ethanol; Heating;

Reference yield:

: 75-15-0,12122-00-8
carbon disulfide

: 42135-76-2
4-(3-chlorophenyl)-3-thiosemicarbazide

: 76462-59-4
5-(3-chloro-anilino)-3H-[1,3,4]thiadiazole-2-thione

Guidance literature:: With potassium hydroxide; at 100 ℃; im Rohr;

Reference yield:

: 2392-68-9
3-chlorophenyl-isothiocyanate

: 76462-59-4
5-(3-chloro-anilino)-3H-[1,3,4]thiadiazole-2-thione

Guidance literature:: Multi-step reaction with 2 steps

1: alcohol; hydrazine hydrate / unter Kuehlung

2: alcoholic KOH-solution / 100 °C / im Rohr

With potassium hydroxide; ethanol; hydrazine hydrate;